1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one

C94H70Cl3F10N5O14 — CID 165041246

IUPAC1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one
SMILESCOc1ccccc1CC(=O)Cc1ccc(-c2cnco2)c(Cl)c1.O=C(Cc1ccc(-c2cnco2)c(F)c1)Cc1cc(F)ccc1Cl.O=C(Cc1ccc(-c2cnco2)c(F)c1)Cc1ccccc1OC(F)F.O=C(Cc1cccc(OC(F)F)c1)Cc1ccc(-c2cnco2)c(Cl)c1.O=C(Cc1cccc(OC(F)F)c1)Cc1ccc(-c2cnco2)c(F)c1
InChIInChI=1S/C19H14ClF2NO3.C19H16ClNO3.2C19H14F3NO3.C18H12ClF2NO2/c20-17-9-13(4-5-16(17)18-10-23-11-25-18)7-14(24)6-12-2-1-3-15(8-12)26-19(21)22;1-23-18-5-3-2-4-14(18)10-15(22)8-13-6-7-16(17(20)9-13)19-11-21-12-24-19;20-17-9-13(4-5-16(17)18-10-23-11-25-18)7-14(24)6-12-2-1-3-15(8-12)26-19(21)22;20-16-8-12(5-6-15(16)18-10-23-11-25-18)7-14(24)9-13-3-1-2-4-17(13)26-19(21)22;19-16-4-2-13(20)7-12(16)8-14(23)5-11-1-3-15(17(21)6-11)18-9-22-10-24-18/h1-5,8-11,19H,6-7H2;2-7,9,11-12H,8,10H2,1H3;1-5,8-11,19H,6-7H2;1-6,8,10-11,19H,7,9H2;1-4,6-7,9-10H,5,8H2
InChIKeyODWJPPMKDUUDOG-UHFFFAOYSA-N
MW1789.95 g/mol
LogP22.81
Rot. Bonds32

About 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one

1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one (PubChem CID 165041246) has the molecular formula C94H70Cl3F10N5O14 and a molecular weight of 1789.95 g/mol. Its IUPAC name is 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one.

Molecular Properties

Compound Name1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one
PubChem CID165041246
Molecular FormulaC94H70Cl3F10N5O14
Molecular Weight1789.95 g/mol
Exact Mass1787.38
IUPAC Name1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one
SMILESCOc1ccccc1CC(=O)Cc1ccc(-c2cnco2)c(Cl)c1.O=C(Cc1ccc(-c2cnco2)c(F)c1)Cc1cc(F)ccc1Cl.O=C(Cc1ccc(-c2cnco2)c(F)c1)Cc1ccccc1OC(F)F.O=C(Cc1cccc(OC(F)F)c1)Cc1ccc(-c2cnco2)c(Cl)c1.O=C(Cc1cccc(OC(F)F)c1)Cc1ccc(-c2cnco2)c(F)c1
InChIInChI=1S/C19H14ClF2NO3.C19H16ClNO3.2C19H14F3NO3.C18H12ClF2NO2/c20-17-9-13(4-5-16(17)18-10-23-11-25-18)7-14(24)6-12-2-1-3-15(8-12)26-19(21)22;1-23-18-5-3-2-4-14(18)10-15(22)8-13-6-7-16(17(20)9-13)19-11-21-12-24-19;20-17-9-13(4-5-16(17)18-10-23-11-25-18)7-14(24)6-12-2-1-3-15(8-12)26-19(21)22;20-16-8-12(5-6-15(16)18-10-23-11-25-18)7-14(24)9-13-3-1-2-4-17(13)26-19(21)22;19-16-4-2-13(20)7-12(16)8-14(23)5-11-1-3-15(17(21)6-11)18-9-22-10-24-18/h1-5,8-11,19H,6-7H2;2-7,9,11-12H,8,10H2,1H3;1-5,8-11,19H,6-7H2;1-6,8,10-11,19H,7,9H2;1-4,6-7,9-10H,5,8H2
InChIKeyODWJPPMKDUUDOG-UHFFFAOYSA-N
XLogP22.81
TPSA252.42 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds32
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001789.95
LogP ≤ 522.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one with MolForge

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Related Compounds

bis(1-(2-chlorophenyl)-3-[3-(hydroxymethyl)-4-pyridin-4-ylphenyl]propan-2-one);1-(2-chlorophenyl)-3-(4-pyridin-4-ylphenyl)propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-(hydroxymethyl)-4-pyridin-4-ylphenyl]propan-2-one;1-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]-3-[2-(trifluoromethyl)phenyl]propan-2-one;1-[3-(hydroxymethyl)-4-pyridin-4-ylphenyl]-3-(2-methoxyphenyl)propan-2-one;1-[3-(hydroxymethyl)-4-pyridin-4-ylphenyl]-3-phenylpropan-2-one
CID 161214006
1-(3-bromophenyl)-3-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-(2-chloro-5-fluorophenyl)-3-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2,4-difluorophenyl)propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[2-(trifluoromethyl)phenyl]propan-2-one
CID 164979501
2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide
CID 90177419
1-(3,4-dichlorophenyl)-3-(3-fluoro-4-methoxyphenyl)propan-2-one
CID 62622130
1-(2,4-difluorophenyl)-3-(3-methoxyphenyl)propan-2-one
CID 62196543
1-(2,4-difluorophenyl)-3-(2-methoxyphenyl)propan-2-one
CID 62196384
1-(3-fluoro-4-methoxyphenyl)-3-pyridin-3-ylpropan-2-one
CID 62620103
1-(5-chloro-2-methoxyphenyl)-3-(2-methoxyphenyl)propan-2-one
CID 62620437
1-(5-chloro-2-fluorophenyl)-3-(3-methoxyphenyl)propan-2-one
CID 103047948
1-(5-chloro-2-methoxyphenyl)-3-(3-chlorophenyl)propan-2-one
CID 62620945
N-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-2-(2-chlorophenyl)acetamide
CID 148839325
2-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanone
CID 146863052

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one?
The IUPAC name of 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one (CID 165041246) is 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one.
What is the SMILES notation for 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one?
The canonical SMILES for 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one is COc1ccccc1CC(=O)Cc1ccc(-c2cnco2)c(Cl)c1.O=C(Cc1ccc(-c2cnco2)c(F)c1)Cc1cc(F)ccc1Cl.O=C(Cc1ccc(-c2cnco2)c(F)c1)Cc1ccccc1OC(F)F.O=C(Cc1cccc(OC(F)F)c1)Cc1ccc(-c2cnco2)c(Cl)c1.O=C(Cc1cccc(OC(F)F)c1)Cc1ccc(-c2cnco2)c(F)c1.
What is the InChIKey of 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one?
The InChIKey is ODWJPPMKDUUDOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClF2NO3.C19H16ClNO3.2C19H14F3NO3.C18H12ClF2NO2/c20-17-9-13(4-5-16(17)18-10-23-11-25-18)7-14(24)6-12-2-1-3-15(8-12)26-19(21)22;1-23-18-5-3-2-4-14(18)10-15(22)8-13-6-7-16(17(20)9-13)19-11-21-12-24-19;20-17-9-13(4-5-16(17)18-10-23-11-25-18)7-14(24)6-12-2-1-3-15(8-12)26-19(21)22;20-16-8-12(5-6-15(16)18-10-23-11-25-18)7-14(24)9-13-3-1-2-4-17(13)26-19(21)22;19-16-4-2-13(20)7-12(16)8-14(23)5-11-1-3-15(17(21)6-11)18-9-22-10-24-18/h1-5,8-11,19H,6-7H2;2-7,9,11-12H,8,10H2,1H3;1-5,8-11,19H,6-7H2;1-6,8,10-11,19H,7,9H2;1-4,6-7,9-10H,5,8H2.
What are the key properties of 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one?
1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one has a molecular weight of 1789.95 g/mol, XLogP of 22.81, 32 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one is sourced from PubChem (CID 165041246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).